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A12B5C
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Ho12PuSc5
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Ho12 Pu1 Sc5
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2023-11-16 06:57:59
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1852ec1ce48beff2f48bbada3802bed0_65_Ho12Pu1Sc5
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A4B4C3
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Ho3Rh4Si4
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Ho3 Si4 Rh4
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2023-11-16 06:57:59
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6fb669205dc2c3b3389e26bd6e12acca_12_Ho3Si4Rh4
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A12B7C
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Ho7Sm12Tb
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Tb1 Sm12 Ho7
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2023-11-16 06:57:59
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| true
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[
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A2BC
|
Ho2ThTm
|
Ho2 Tm1 Th1
| 3
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[
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"Tm",
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2023-11-16 06:57:59
|
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|
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|
[
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A3BC
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IIrO3
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Ir1 I1 O3
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2023-11-16 06:57:59
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pbe
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|
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ABC
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INaNi
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Na4 Ni4 I4
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2023-11-16 06:57:59
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1812c7843a9842677f7e14417ed991d4_62_Na4Ni4I4
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I9Na4Pr2
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Na8 Pr4 I18
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2023-11-16 06:57:59
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50fc92e213f8f9c0d6471a1a21990c42_2_Na8Pr4I18
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A5B2C
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INd5Si2
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Nd10 Si4 I2
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2023-11-16 06:57:59
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3a5607ee027f85e55739063edc06ddd4_140_Nd10Si4I2
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INiS
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Ni2 S2 I2
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2023-11-16 06:57:59
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[
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A2B2C
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I2Ni2Se
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Ni4 Se2 I4
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2023-11-16 06:57:59
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A2BC
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IO2Sn
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Sn1 I1 O2
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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A4B2C
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ITe2Tl4
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Tl8 Te4 I2
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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K1 Tl2 In1
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2023-11-16 06:57:59
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979118adcd5300165ee8b35408c52692_166_K1Tl2In1
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[
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A3B3C2
|
In3La3Nd2
|
La3 Nd2 In3
| 3
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1
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agm003332173
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2023-11-16 06:57:59
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pbe
| true
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e67e6a16928e96b6b73b212f75624cda_189_La3Nd2In3
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[
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A5B2C
|
In2La5Pm
|
La10 Pm2 In4
| 3
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2023-11-16 06:57:59
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pbe
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2fda02048742ea29489a50d52891280f_63_La10Pm2In4
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[
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A2BC
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InLaSi2
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La1 In1 Si2
| 3
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agm004139798
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[
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2023-11-16 06:57:59
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pbe
| true
|
c2e968eac32feaef87869259c606e732_25_La1In1Si2
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[
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A3B2C
|
In3LaTm2
|
La1 Tm2 In3
| 3
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agm003410146
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[
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2023-11-16 06:57:59
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pbe
| true
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d7704c594d65b85eecb022c633002845_123_La1Tm2In3
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[
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A8B3C2
|
In8Li2Pd3
|
Li2 In8 Pd3
| 3
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[
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agm005642931
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2023-11-16 06:57:59
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pbe
| true
|
82c483b65faeeda363b0c52ae2440a49_10_Li2In8Pd3
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[
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A2B2C
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In2MgPt2
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Mg2 In4 Pt4
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agm002995174
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2023-11-16 06:57:59
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pbe
| true
|
364d2a94195e8dde6d92d6ece26fc5e9_127_Mg2In4Pt4
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[
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A4BC
|
InNaS4
|
Na2 In2 S8
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agm005918973
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2023-11-16 06:57:59
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Nd2 In2 Se6
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2023-11-16 06:57:59
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Pm7 Y12 In1
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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A2BC
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In2NiSc
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Sc2 In4 Ni2
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2023-11-16 06:57:59
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A2BC
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InNi2W
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2023-11-16 06:57:59
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A3BC
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InOSr3
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Sr6 In2 O2
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2023-11-16 06:57:59
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pbe
| true
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78ef8e8fff5642fe7198089d90e77aa7_119_Sr6In2O2
|
[
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ABC
|
InOsPt
|
In2 Os2 Pt2
| 3
|
[
1,
1,
1
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|
[
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agm002088759
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2023-11-16 06:57:59
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pbe
| true
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f158679076b39a54b4d84df2a1bd9f8e_25_In2Os2Pt2
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[
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A2BC
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InPd2Th
|
Th1 In1 Pd2
| 3
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[
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[
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agm001148372
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2023-11-16 06:57:59
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pbe
| true
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b56c1c6ff1da06d88049378c3fd3fcad_123_Th1In1Pd2
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[
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A6BC
|
InPd6V
|
V1 In1 Pd6
| 3
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[
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1,
1
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[
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agm005771600
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[
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2023-11-16 06:57:59
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pbe
| true
|
bc035b987bfd770643e45aba1a14e13a_123_V1In1Pd6
|
[
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A12B6C
|
In6Pd12Y
|
Y1 In6 Pd12
| 3
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[
1,
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1
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[
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2023-11-16 06:57:59
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[
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pbe
| true
|
b4cb0cf7b16892e44ccd65ff74383988_148_Y1In6Pd12
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[
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ABC
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InPtSm
|
Sm2 In2 Pt2
| 3
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[
1,
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[
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agm003610322
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[
"Sm",
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2023-11-16 06:57:59
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[
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pbe
| true
|
aa62560191031a982fa1512fe70bf151_12_Sm2In2Pt2
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[
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A3B3C2
|
In3Pt2Ta3
|
Ta3 In3 Pt2
| 3
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[
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[
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2023-11-16 06:57:59
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[
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pbe
| true
|
5a1e1c613dcb266cddb23aa03fbc5f7d_189_Ta3In3Pt2
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[
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A4B2C
|
In4Rh2Sr
|
Sr4 In16 Rh8
| 3
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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-2.795167349080457,
1.618972999314306,
5.292199669733716
]
] |
[{"mass": null, "name": "In", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["In"]}, {"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}, {"mass": null, "name": "Sr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sr"]}]
|
[
"Sr",
"In",
"In",
"Te",
"Te",
"Te",
"Te"
] |
2023-11-16 06:57:59
|
[
0.2857142857142857,
0.14285714285714285,
0.5714285714285714
] |
[
[
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3.8e-7
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[
0.01639304,
1.1303065,
-2.2e-7
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[
-3.8e-7,
2.2e-7,
1.1020038
]
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[
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[
[
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[
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| -0.00078
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pbe
| true
|
5ea54434367083d094e694f1101f87ec_87_Sr1In2Te4
|
[
"In",
"Tc",
"W"
] | 8
|
A2BC
|
In2TcW
|
In4 Tc2 W2
| 3
|
[
1,
1,
1
] | 3
|
[
[
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0,
0
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[
0,
7.54247493,
0
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[
3.77123747,
3.77123747,
2.79531729
]
] |
agm002896318
|
[
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2.0964879675
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9.366614425122325,
2.0964879675
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[{"mass": null, "name": "In", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["In"]}, {"mass": null, "name": "W", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["W"]}, {"mass": null, "name": "Tc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tc"]}]
|
[
"Tc",
"Tc",
"W",
"W",
"In",
"In",
"In",
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] |
2023-11-16 06:57:59
|
[
0.5,
0.25,
0.25
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[
[
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[
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0
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[
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[
0.937,
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0.004,
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[
0,
-0.00273916,
0
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[
0,
0.00273916,
0
]
] | 1.534405
| 8.153634
|
pbe
| true
|
6f0f6689ffd28a1192ae14b6fc21c13e_122_In4Tc2W2
|
[
"Ir",
"La",
"Tl"
] | 5
|
A2B2C
|
Ir2LaTl2
|
La1 Tl2 Ir2
| 3
|
[
1,
1,
1
] | 3
|
[
[
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0,
0
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[
0,
4.4126307,
0
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[
2.20631535,
2.20631535,
6.04744102
]
] |
agm002928247
|
[
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[
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4.412630677936846,
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[
0,
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0
]
] |
[{"mass": null, "name": "Tl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tl"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "La", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["La"]}]
|
[
"Tl",
"Tl",
"Ir",
"Ir",
"La"
] |
2023-11-16 06:57:59
|
[
0.4,
0.2,
0.4
] |
[
[
4.0561724,
0,
0
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[
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0
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[
0,
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]
] | -27.960207
|
[
0,
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[
[
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[
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[
0,
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-0.032062
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[
0,
0,
0
]
] | -0.000001
| 3.607107
|
pbe
| true
|
25f40812cbdc682df981f2c90382802b_139_La1Tl2Ir2
|
[
"Ir",
"Li",
"Tb"
] | 12
|
A8B3C
|
Ir8LiTb3
|
Li1 Tb3 Ir8
| 3
|
[
1,
1,
1
] | 3
|
[
[
5.32740659,
0,
0
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[
2.66370329,
4.61366944,
0
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[
2.66370329,
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agm003586816
|
[
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[
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1.6316923496080011
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[
7.991109852740976,
3.0805430381542958,
5.961348881206311
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] |
[{"mass": null, "name": "Tb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tb"]}, {"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
|
[
"Li",
"Tb",
"Tb",
"Tb",
"Ir",
"Ir",
"Ir",
"Ir",
"Ir",
"Ir",
"Ir",
"Ir"
] |
2023-11-16 06:57:59
|
[
0.6666666666666666,
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0.25
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[
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[
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[
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[
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[
0,
0.00114228,
-0.0036737
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[
0,
-0.00125144,
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]
] | 0.000698
| 13.457924
|
pbe
| true
|
ebb4e67ed2eb2333a7c1474480424fad_160_Li1Tb3Ir8
|
[
"Ir",
"Li",
"Sn"
] | 10
|
A2B2C
|
IrLi2Sn2
|
Li4 Sn4 Ir2
| 3
|
[
1,
1,
1
] | 3
|
[
[
6.51555976,
0,
0
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[
0,
6.51555976,
0
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[
0,
0,
3.9846063
]
] |
agm002989490
|
[
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0
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[{"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}, {"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
|
[
"Ir",
"Ir",
"Sn",
"Sn",
"Sn",
"Sn",
"Li",
"Li",
"Li",
"Li"
] |
2023-11-16 06:57:59
|
[
0.2,
0.4,
0.4
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[
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0,
0
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[
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0
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[
0,
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]
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[
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[
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[
0.00042607,
0.00042607,
0
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[
0.00042607,
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0
]
] | 0
| 5.667527
|
pbe
| true
|
1fc37fb190d62796a6f5a470cffacd66_127_Li4Sn4Ir2
|
[
"Ir",
"Mg",
"Tc"
] | 3
|
ABC
|
IrMgTc
|
Mg1 Tc1 Ir1
| 3
|
[
1,
1,
1
] | 3
|
[
[
0,
2.9870879,
2.9870879
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[
2.9870879,
0,
2.9870879
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[
2.9870879,
2.9870879,
0
]
] |
agm003101920
|
[
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4.48063185
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[
2.9870879,
2.9870879,
2.9870879
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[
1.49354395,
1.49354395,
1.49354395
]
] |
[{"mass": null, "name": "Tc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tc"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
|
[
"Mg",
"Ir",
"Tc"
] |
2023-11-16 06:57:59
|
[
0.3333333333333333,
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0.3333333333333333
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[
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[
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0
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[
0,
0,
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]
] | -20.325671
|
[
0,
0,
0
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[
[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0
]
] | 0
| 2.041115
|
pbe
| true
|
d9431f84bf404014e3eed92cad92edf0_216_Mg1Tc1Ir1
|
[
"Ir",
"Mn",
"Mo"
] | 4
|
A2BC
|
IrMn2Mo
|
Mn2 Mo1 Ir1
| 3
|
[
1,
1,
1
] | 3
|
[
[
8.89251143,
-0.00282858,
-0.00165845
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[
8.48674438,
2.65554841,
-0.00165845
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[
8.48674438,
1.29539235,
2.31816711
]
] |
agm004000494
|
[
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2.961084135,
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[
0.0719351571484033,
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1.9630761136595676,
1.1509873445264753
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[
6.4665000475,
0.987028045,
0.5787125525
]
] |
[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Mo", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mo"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
|
[
"Ir",
"Mn",
"Mn",
"Mo"
] |
2023-11-16 06:57:59
|
[
0.25,
0.5,
0.25
] |
[
[
3.7560568,
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-0.01625609
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[
-0.02772571,
3.9334695,
-0.00248128
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[
-0.01625609,
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3.9362466
]
] | -37.369903
|
[
-0.271,
1.906,
1.906,
-0.112
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[
[
0,
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0
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[
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[
0.00365488,
0.00055787,
0.00032709
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[
0,
0,
0
]
] | 3.543057
| 4.606803
|
pbe
| true
|
38265fffcb44d85c1102dd39c67e0452_166_Mn2Mo1Ir1
|
[
"Ir",
"Nb",
"Sn"
] | 8
|
A2BC
|
IrNbSn2
|
Nb2 Sn4 Ir2
| 3
|
[
1,
1,
1
] | 3
|
[
[
7.65702592,
0,
0
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[
0,
7.65702592,
0
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[
3.82851296,
3.82851296,
2.87208499
]
] |
agm002867314
|
[
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0
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3.82851296,
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[
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1.91425648,
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5.74276944,
0.7180212475
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[
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5.496297662371897,
2.1540637425
],
[
9.5712824,
9.817754177628101,
2.1540637425
]
] |
[{"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}, {"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
|
[
"Nb",
"Nb",
"Ir",
"Ir",
"Sn",
"Sn",
"Sn",
"Sn"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.5
] |
[
[
2.7814388,
0,
0
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[
0,
2.7814388,
0
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[
0,
0,
8.183734
]
] | -51.307937
|
[
0,
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0
] |
[
[
0,
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0
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[
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[
0,
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[
0,
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[
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[
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0,
0
],
[
0,
0.01331049,
0
],
[
0,
-0.01331049,
0
]
] | 0.000058
| 8.866352
|
pbe
| true
|
8ad859f8a132ab35f17b4abda7211df7_122_Nb2Sn4Ir2
|
[
"Ir",
"Nb",
"Te"
] | 6
|
A4BC
|
IrNbTe4
|
Nb1 Te4 Ir1
| 3
|
[
1,
1,
1
] | 3
|
[
[
1.89200592,
7.15026867,
-0.46861802
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[
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[
0,
1.43186304,
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]
] |
agm005843990
|
[
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5.864234001021012,
1.9316836915044677
],
[
0,
7.15026867,
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]
] |
[{"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}, {"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
|
[
"Nb",
"Te",
"Te",
"Te",
"Te",
"Ir"
] |
2023-11-16 06:57:59
|
[
0.16666666666666666,
0.16666666666666666,
0.6666666666666666
] |
[
[
1.909781,
0,
0
],
[
0,
1.8497652,
-0.04509569
],
[
0,
-0.04509567,
1.6481606
]
] | -32.89453
|
[
0,
0,
0,
0,
0,
0
] |
[
[
0,
0,
0
],
[
0,
-0.00313997,
0.00147357
],
[
0,
0.00313997,
-0.00147357
],
[
0,
-0.00593333,
0.00157573
],
[
0,
0.00593333,
-0.00157573
],
[
0,
0,
0
]
] | 0.000002
| 2.595813
|
pbe
| true
|
2de2360e1a4eef30853a1f61d9d84ee6_12_Nb1Te4Ir1
|
[
"Ir",
"Os",
"Sr"
] | 10
|
A3BC
|
IrOsSr3
|
Ir1 Os1 Sr3
| 3
|
[
1,
1,
1
] | 3
|
[
[
5.041546689,
0,
0
],
[
0,
4.176214728,
7.234308045
],
[
0,
-4.176214728,
7.234308045
]
] |
oqmd-6279271
|
[
[
0,
-5.746779535162373e-17,
4.82251
],
[
2.52077,
-5.746779535162373e-17,
4.82251
],
[
0,
0,
0
],
[
2.52077,
0,
0
],
[
1.26039,
1.3918,
7.249790000000001
],
[
3.7811599999999994,
2.77012,
9.63782
],
[
3.7811599999999994,
-1.3918,
7.249790000000001
],
[
1.26039,
1.3783700000000003,
12.049070000000002
],
[
1.26039,
-2.7701199999999995,
9.637819999999998
],
[
3.7811599999999994,
-1.37837,
12.049070000000002
]
] |
[{"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}, {"mass": null, "name": "Sr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sr"]}]
|
[
"Ir",
"Ir",
"Os",
"Os",
"Sr",
"Sr",
"Sr",
"Sr",
"Sr",
"Sr"
] |
2024-11-01 00:00:00
|
[
0.2,
0.2,
0.6
] |
[
[
-3.16882157,
0,
0
],
[
0,
47.96249167,
0
],
[
0,
0,
47.94594685
]
] | -49.0931
|
[
0,
0,
-0.001,
-0.001,
0,
0,
0,
0,
0,
0
] |
[
[
0,
0,
0.000093
],
[
0,
0,
0.000093
],
[
0,
0,
-0.000331
],
[
0,
0,
-0.000331
],
[
0,
-0.034097,
-0.037234
],
[
0,
0.015361,
0.048483
],
[
0,
0.034097,
-0.037234
],
[
0,
0.049385,
-0.011011
],
[
0,
-0.015361,
0.048483
],
[
0,
-0.049385,
-0.011011
]
] | -0.022321
| null |
pbe
| true
|
66b2268f5a26800048433fb855c3d286_188_Sr6Ir2Os2
|
[
"Ir",
"P",
"Se"
] | 4
|
A2BC
|
IrP2Se
|
P2 Ir1 Se1
| 3
|
[
1,
1,
1
] | 3
|
[
[
3.78835177,
0,
0
],
[
0,
4.16672836,
-0.00700777
],
[
0,
0.52656996,
4.89773939
]
] |
agm004339350
|
[
[
1.894175885,
3.5599105748896385,
4.064770172343476
],
[
0,
3.8120801831323106,
0.4173991113643686
],
[
1.894175885,
1.0188015804060846,
0.3092837804933268
],
[
0,
2.8158835068376646,
2.5376366447762226
]
] |
[{"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "P", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["P"]}]
|
[
"Ir",
"P",
"P",
"Se"
] |
2023-11-16 06:57:59
|
[
0.25,
0.5,
0.25
] |
[
[
0.99421865,
0,
0
],
[
0,
1.2328147,
0.11927288
],
[
0,
0.11927283,
1.3418623
]
] | -23.316234
|
[
0,
0,
0,
0
] |
[
[
0,
0.00213587,
0.00550641
],
[
0,
-0.00281053,
-0.0002566
],
[
0,
0.00101942,
-0.00227597
],
[
0,
-0.00034476,
-0.00297384
]
] | 0.000001
| 1.287465
|
pbe
| true
|
c83d9cd6a1fcfabe45222cfe2475d507_6_P2Ir1Se1
|
[
"Ir",
"P",
"Sr"
] | 10
|
A2B2C
|
Ir2P2Sr
|
Sr2 P4 Ir4
| 3
|
[
1,
1,
1
] | 3
|
[
[
6.18088798,
0.00289787,
2.65252262
],
[
3.11565989,
5.62815627,
1.26585901
],
[
1.02514189,
-0.06774726,
6.13281577
]
] |
agm005832168
|
[
[
7.947025919083925,
4.204186084582635,
4.781831306609759
],
[
2.3746301485371317,
1.3591197923801195,
5.269354208238252
],
[
4.910783483972525,
2.3362367320457293,
3.733120388453185
],
[
8.3421434436241,
5.115252925020436,
8.017405361625197
],
[
1.9795177427961415,
0.44804801035525077,
2.03378178641133
],
[
5.410874021068368,
3.2270708584817287,
6.318068339906374
],
[
6.386621064983385,
3.9384031923231646,
8.255926656249768
],
[
6.082866266525541,
1.15903544642135,
5.31670273281216
],
[
3.9350351962984584,
1.6249022339124666,
1.795259004334264
],
[
4.238787654128831,
4.404267589578178,
4.734484116500878
]
] |
[{"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "Sr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sr"]}, {"mass": null, "name": "P", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["P"]}]
|
[
"Sr",
"Sr",
"P",
"P",
"P",
"P",
"Ir",
"Ir",
"Ir",
"Ir"
] |
2023-11-16 06:57:59
|
[
0.4,
0.4,
0.2
] |
[
[
1.5787355,
0.02080904,
0.03629386
],
[
0.02080898,
1.6199359,
-0.04321405
],
[
0.03629392,
-0.04321407,
1.5307873
]
] | -68.851364
|
[
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
] |
[
[
-0.00086474,
-0.00032015,
0.00022913
],
[
0.00086474,
0.00032015,
-0.00022913
],
[
-0.00050218,
-0.00145754,
0.00219712
],
[
-0.00128444,
0.00088521,
0.0022902
],
[
0.00128444,
-0.00088521,
-0.0022902
],
[
0.00050218,
0.00145754,
-0.00219712
],
[
0.00151658,
0.00472677,
0.00273854
],
[
-0.00311655,
0.00428829,
0.000662
],
[
-0.00151658,
-0.00472677,
-0.00273854
],
[
0.00311655,
-0.00428829,
-0.000662
]
] | 0.000001
| 3.372321
|
pbe
| true
|
fdd1c3d900c2591948ba4b4886426a32_2_Sr2P4Ir4
|
[
"Ir",
"P",
"Zn"
] | 4
|
A2BC
|
IrPZn2
|
Zn2 P1 Ir1
| 3
|
[
1,
1,
1
] | 3
|
[
[
2.84917047,
0,
0
],
[
0,
2.84917047,
0
],
[
0,
0,
7.74686084
]
] |
agm004244308
|
[
[
0,
0,
0.117000064580436
],
[
1.424585235,
1.424585235,
2.0679212355830026
],
[
1.424585235,
1.424585235,
5.398771050988236
],
[
0,
0,
4.036598908848325
]
] |
[{"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}, {"mass": null, "name": "P", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["P"]}]
|
[
"Zn",
"Zn",
"P",
"Ir"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.5
] |
[
[
3.2464423,
0,
0
],
[
0,
3.2464423,
0
],
[
0,
0,
2.7808974
]
] | -17.085037
|
[
0,
0,
0,
0
] |
[
[
0,
0,
-0.00414933
],
[
0,
0,
-0.00348396
],
[
0,
0,
0.00175894
],
[
0,
0,
0.00587435
]
] | 0.000002
| 1.099434
|
pbe
| true
|
06d8bb05e9a54c48007eb2ef67cb7765_99_Zn2P1Ir1
|
[
"Ir",
"P",
"Y"
] | 4
|
A2BC
|
Ir2PY
|
Y1 P1 Ir2
| 3
|
[
1,
1,
1
] | 3
|
[
[
1.89295029,
4.39362137,
-0.0076185
],
[
-1.89295029,
4.39362137,
-0.0076185
],
[
0,
1.46891677,
4.52227382
]
] |
agm004223835
|
[
[
8.231173420696507e-17,
7.656480858045333,
3.390027868347697
],
[
-1.0713598797798338e-17,
5.18289696047345,
1.6677592264278487
],
[
4.4757781923405557e-17,
8.757966508691803,
0.6162420249171776
],
[
-1.127606751112893e-17,
2.574137677789413,
1.071289110307276
]
] |
[{"mass": null, "name": "P", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["P"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
|
[
"Y",
"P",
"Ir",
"Ir"
] |
2023-11-16 06:57:59
|
[
0.5,
0.25,
0.25
] |
[
[
1.7624125,
0,
0
],
[
0,
1.7520895,
-0.06436119
],
[
0,
-0.06436117,
1.5576423
]
] | -31.852494
|
[
0,
0,
0,
0
] |
[
[
0,
0.00186461,
-0.0018726
],
[
0,
-0.00508786,
-0.0026125
],
[
0,
0.0008984,
0.00325656
],
[
0,
0.00232485,
0.00122853
]
] | 0
| 2.379011
|
pbe
| true
|
02c6b934fa2e06c3dd8c82a86ce1e511_8_Y1P1Ir2
|
[
"Ir",
"Pb",
"Re"
] | 4
|
A2BC
|
Ir2PbRe
|
Re1 Ir2 Pb1
| 3
|
[
1,
1,
1
] | 3
|
[
[
2.886063,
-0.00052365,
0
],
[
0.00028934,
2.88606303,
0
],
[
0,
0,
8.3983496
]
] |
agm003810632
|
[
[
0,
0,
8.054421227015759
],
[
0,
0,
4.54310317298424
],
[
1.44317617,
1.44276969,
2.0995874
],
[
1.44317617,
1.44276969,
6.2987622
]
] |
[{"mass": null, "name": "Pb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pb"]}, {"mass": null, "name": "Re", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Re"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
|
[
"Ir",
"Ir",
"Pb",
"Re"
] |
2023-11-16 06:57:59
|
[
0.5,
0.25,
0.25
] |
[
[
10.571628,
0.05749816,
0
],
[
0.05749816,
10.571595,
0
],
[
0,
0,
11.243774
]
] | -32.783058
|
[
0,
0,
0,
0
] |
[
[
0,
0,
0.02486131
],
[
0,
0,
-0.02486131
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 0.000005
| 2.848456
|
pbe
| true
|
6291be4ebcb28c12a37f36251edce4c1_123_Re1Ir2Pb1
|
[
"Ir",
"Pr",
"Sn"
] | 16
|
A5B2C
|
IrPr5Sn2
|
Pr10 Sn4 Ir2
| 3
|
[
1,
1,
1
] | 3
|
[
[
6.01718216,
0,
0
],
[
-3.00859108,
5.1427613,
0
],
[
0,
0,
16.28581674
]
] |
agm003469904
|
[
[
3.008591049914089,
4.327549858368423,
14.424867892746509
],
[
3.008591049914089,
4.327549858368423,
10.003857217253493
],
[
3.008591077993277e-8,
4.325827856174731,
6.280492170658235
],
[
3.008591077993277e-8,
4.325827856174731,
1.8624161993417658
],
[
3.0085910800000004,
2.569905294638256,
4.071454185
],
[
1.7107792544175026e-17,
2.572856005361744,
12.214362555000001
],
[
3.008591049914089,
0.816933443825269,
10.005324569341767
],
[
3.008591049914089,
0.816933443825269,
14.423400540658236
],
[
3.008591080007819e-8,
0.815211441631577,
1.8609488472534919
],
[
3.008591080007819e-8,
0.815211441631577,
6.281959522746509
],
[
3.0085910799999995,
2.5707435647301558,
7.2744466722104075
],
[
3.0085910799999995,
2.5707435647301558,
0.8684616977895925
],
[
-1.084211872079436e-16,
2.572017735269844,
9.011370067789592
],
[
-1.084211872079436e-16,
2.572017735269844,
15.41735504221041
],
[
3.00859108,
2.5733077455143363,
12.214362555000001
],
[
-9.908075405969043e-17,
2.5694535544856643,
4.071454185
]
] |
[{"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}, {"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
|
[
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Pr",
"Sn",
"Sn",
"Sn",
"Sn",
"Ir",
"Ir"
] |
2023-11-16 06:57:59
|
[
0.125,
0.625,
0.25
] |
[
[
1.5713829,
0,
0
],
[
0,
1.6819676,
0
],
[
0,
0,
1.7920226
]
] | -88.20001
|
[
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
] |
[
[
0,
-0.00087593,
-0.00253414
],
[
0,
-0.00087593,
0.00253414
],
[
0,
0.00065798,
-0.0027054
],
[
0,
0.00065798,
0.0027054
],
[
0,
0.00130667,
0
],
[
0,
-0.00130667,
0
],
[
0,
-0.00065798,
0.0027054
],
[
0,
-0.00065798,
-0.0027054
],
[
0,
0.00087593,
0.00253414
],
[
0,
0.00087593,
-0.00253414
],
[
0,
0.00008891,
-0.0004293
],
[
0,
0.00008891,
0.0004293
],
[
0,
-0.00008891,
0.0004293
],
[
0,
-0.00008891,
-0.0004293
],
[
0,
-0.00087893,
0
],
[
0,
0.00087893,
0
]
] | -0.000002
| 12.87489
|
pbe
| true
|
3eafbad3195374febd4c18478b763d42_69_Pr10Sn4Ir2
|
[
"Ir",
"Sm",
"Sr"
] | 5
|
A3BC
|
IrSm3Sr
|
Sr1 Sm3 Ir1
| 3
|
[
1,
1,
1
] | 3
|
[
[
5.63934364,
0,
0
],
[
0,
5.63934364,
0
],
[
0,
0,
5.63934364
]
] |
agm001110573
|
[
[
2.81967182,
2.81967182,
2.81967182
],
[
0,
0,
0
],
[
0,
2.81967182,
0
],
[
0,
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|
[
"Sr",
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2023-11-16 06:57:59
|
[
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pbe
| true
|
3c3ef8b8fdc7e5f1152482c6c2f1f531_221_Sr1Sm3Ir1
|
[
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|
A9B2C
|
Ir9U2Zn
|
U2 Zn1 Ir9
| 3
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[
1,
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1
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agm005869648
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|
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"U",
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2023-11-16 06:57:59
|
[
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pbe
| true
|
590439e253d22bf7bf017cca4b5e8738_123_U2Zn1Ir9
|
[
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A2B2C
|
KLa2O2
|
K1 La2 O2
| 3
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[
1,
1,
1
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[
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agm002938502
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[
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2023-11-16 06:57:59
|
[
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pbe
| true
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2e210a59d4142e648abc5fc4a1bc6113_139_K1La2O2
|
[
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A12B6C
|
KLi6Sn12
|
K1 Li6 Sn12
| 3
|
[
1,
1,
1
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|
[
[
8.14404648,
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agm003684446
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|
[
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2023-11-16 06:57:59
|
[
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[
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pbe
| true
|
673ab485d75a6e54d574a2b3947d8e06_166_K1Li6Sn12
|
[
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|
A3BC
|
KMnSb3
|
K1 Mn1 Sb3
| 3
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[
1,
1,
1
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[
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agm002503351
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|
[
"Sb",
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2023-11-16 06:57:59
|
[
0.2,
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0.6
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[
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[
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|
pbe
| true
|
67fdd0bc3ade5dc031dce898e0912537_221_K1Mn1Sb3
|
[
"K",
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|
A2B2C
|
K2Na2Pb
|
K2 Na2 Pb1
| 3
|
[
1,
1,
1
] | 3
|
[
[
5.79265168,
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1.0814842
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agm005837932
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|
[
"K",
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2023-11-16 06:57:59
|
[
0.4,
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0.2
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[
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[
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[
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| 1.767201
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pbe
| true
|
2dd174e3a7206ead4581a2950c4ee02d_166_K2Na2Pb1
|
[
"K",
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"Tl"
] | 4
|
A2BC
|
K2NaTl
|
K2 Na1 Tl1
| 3
|
[
1,
1,
1
] | 3
|
[
[
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agm001961204
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[{"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Tl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tl"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}]
|
[
"Na",
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2023-11-16 06:57:59
|
[
0.5,
0.25,
0.25
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[
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[
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[
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[
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[
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|
pbe
| true
|
c313be68427b863d79ae39b48d84b26d_166_K2Na1Tl1
|
[
"K",
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|
A8B3C
|
KNb3O8
|
K2 Nb6 O16
| 3
|
[
1,
1,
1
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|
[
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11.05739187,
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agm003232818
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2023-11-16 06:57:59
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[
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0.6666666666666666
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pbe
| true
|
f9c11cc9abbbb7c63b2518c22121aff5_63_K2Nb6O16
|
[
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|
A4BC
|
K4NiSe
|
K4 Ni1 Se1
| 3
|
[
1,
1,
1
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|
[
[
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4.74045778
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agm005442253
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[
"K",
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2023-11-16 06:57:59
|
[
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pbe
| true
|
70db5650664a3e5e5d3f6e0c1caee099_216_K4Ni1Se1
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[
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A2BC
|
KOPt2
|
K2 Pt4 O2
| 3
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[
1,
1,
1
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[
[
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agm002871056
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[
"K",
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2023-11-16 06:57:59
|
[
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pbe
| true
|
ae0c1edc9177a9c961908bbeef1e383a_141_K2Pt4O2
|
[
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A5B2C2
|
K2O5Sn2
|
K2 Sn2 O5
| 3
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[
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agm003316662
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|
[
"K",
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2023-11-16 06:57:59
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[
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pbe
| true
|
e1ef2581af303b3c70ac998d5732ef4c_12_K2Sn2O5
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[
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|
A2BC
|
K2OSe
|
K2 Se1 O1
| 3
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[
1,
1,
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[
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agm002720673
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[
"K",
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2023-11-16 06:57:59
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[
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pbe
| true
|
35062f3909aa32b1fbcd73770d43dc45_225_K2Se1O1
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[
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A3BC
|
KO3Tc
|
K2 Tc2 O6
| 3
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[
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1
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[
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agm003128429
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2023-11-16 06:57:59
|
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pbe
| true
|
931c4afa453d6a6b919343f75cb96dbc_2_K2Tc2O6
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[
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A7B2C2
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K2O7W2
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K4 W4 O14
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agm003229143
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2023-11-16 06:57:59
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| true
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b3d5032fb4a12389a9c0280f03849079_14_K4W4O14
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[
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A8B6C
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KRu6S8
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K1 Ru6 S8
| 3
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2023-11-16 06:57:59
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pbe
| true
|
2559c15f253484875cff09df6b7290f1_148_K1Ru6S8
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[
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A2BC
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KSn2Ti
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K1 Ti1 Sn2
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2023-11-16 06:57:59
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| true
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A8B3C
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K3SrTl8
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K3 Sr1 Tl8
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2023-11-16 06:57:59
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4930b3419c45468fb3a69ea79ed7962d_160_K3Sr1Tl8
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[
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A3B3C
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KTe3Tl3
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K2 Tl6 Te6
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agm2000105545
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2023-11-16 06:57:59
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[
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| true
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0b03659f050fc003f98ec9dd133f2f61_30_K2Tl6Te6
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A4B4C
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K4Tl4Zn
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K4 Tl4 Zn1
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2023-11-16 06:57:59
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c210106e77330f10dd9a4c36f4380e94_121_K4Tl4Zn1
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A15B4C
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La15Nd4Pb
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La15 Nd4 Pb1
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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LaPd2Ti
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La1 Ti1 Pd2
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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LaRh3Th2
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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c5b7e5c4cc4aa2693c331c7f6a363058_166_La1W4S8
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A3B2C
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La3Sb2Sm
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2023-11-16 06:57:59
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2cb0800cb95d4384428940290d43fb48_115_La3Sm1Sb2
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LaTl3Tm6
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2020-07-18 00:53:28
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|
pbe
| true
|
7b605832f092240e079d9c8ad95343f9_230_Li20Mo12O48
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[
"Li",
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A2BC
|
LiN2Os
|
Li4 Os4 N8
| 3
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[
1,
1,
1
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agm005284721
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2023-11-16 06:57:59
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pbe
| true
|
48cab64bb789e3f427c954adf1804484_33_Li4Os4N8
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[
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A2B2C
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Li2Na2Sr
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Na2 Sr1 Li2
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agm002928376
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[
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2023-11-16 06:57:59
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[
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pbe
| true
|
6445216c7cd81900dff1b5c47020822b_139_Na2Sr1Li2
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[
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A5BC
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Li5NaZn
|
Na1 Li5 Zn1
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[
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[
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agm005762487
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[
"Na",
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2023-11-16 06:57:59
|
[
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pbe
| true
|
544a7d16874a56e5ff68bd6ec8ee2099_123_Na1Li5Zn1
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